PPP(2'-5')-A-A-A triethyl ammonium salt
TL;DR: PPP(2'-5')-A-A-A triethyl ammonium salt (CAS 78549-90-3) is a chemical compound with molecular formula C36H55N16O25P5 and molecular weight 1266.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[5-(6-aminopurin-9-yl)-4-[[5-(6-aminopurin-9-yl)-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;N,N-diethylethanamine
Also Known As: PPP(2'-5')-A-A-A triethyl ammonium salt, AMMONIUM SALT, PPP (2'-5') A-A-A TRIETHYL, [[5-(6-aminopurin-9-yl)-4-[[5-(6-aminopurin-9-yl)-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate; N,N-diethylethanamine
| Molecular Formula | C36H55N16O25P5 |
|---|---|
| Molecular Weight | 1266.22 g/mol |
| LogP | -1.9157 |
| Topological Polar Surface Area | 592.0 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 38 |
| Rotatable Bonds | 23 |
| Exact Mass | 1266.2212 |
| Heavy Atoms | 82 |
| Complexity | 2290.0 |
Chemical Identifiers
| CAS Number | 78549-90-3 |
|---|---|
| SMILES | CCN(CC)CC.C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OC4C(C(OC4N5C=NC6=C(N=CN=C65)N)COP(=O)(O)OC7C(C(OC7N8C=NC9=C(N=CN=C98)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)O)O)N |
| InChIKey | ZIEAURZULXATGE-UHFFFAOYSA-N |
Product Overview
PPP(2'-5')-A-A-A triethyl ammonium salt (CAS 78549-90-3), with molecular formula C36H55N16O25P5 and molecular weight 1266.22 g/mol. IUPAC: [[5-(6-aminopurin-9-yl)-4-[[5-(6-aminopurin-9-yl)-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;N,N-diethylethanamine.
Chemical Property Profile of PPP(2'-5')-A-A-A triethyl ammonium salt
Property Insights of PPP(2'-5')-A-A-A triethyl ammonium salt
The XLogP value of -1.9157 indicates that PPP(2'-5')-A-A-A triethyl ammonium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 592.0 Ų indicates high polarity, suggesting PPP(2'-5')-A-A-A triethyl ammonium salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, PPP(2'-5')-A-A-A triethyl ammonium salt has 13 hydrogen bond donor(s) and 38 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of PPP(2'-5')-A-A-A triethyl ammonium salt?
The CAS number of PPP(2'-5')-A-A-A triethyl ammonium salt is 78549-90-3.
What is the molecular formula of PPP(2'-5')-A-A-A triethyl ammonium salt?
The molecular formula of PPP(2'-5')-A-A-A triethyl ammonium salt is C36H55N16O25P5.
What is the molecular weight of PPP(2'-5')-A-A-A triethyl ammonium salt?
The molecular weight of PPP(2'-5')-A-A-A triethyl ammonium salt is 1266.22 g/mol.
Where can I buy PPP(2'-5')-A-A-A triethyl ammonium salt?
You can request a quote for PPP(2'-5')-A-A-A triethyl ammonium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PPP(2'-5')-A-A-A triethyl ammonium salt?
Yes, KEHONG BIO provides custom synthesis services for PPP(2'-5')-A-A-A triethyl ammonium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.